N-cyclohexyloxypropan-2-imine

C9H17NO — CID 130635287

IUPACN-cyclohexyloxypropan-2-imine
SMILESCC(C)=NOC1CCCCC1
InChIInChI=1S/C9H17NO/c1-8(2)10-11-9-6-4-3-5-7-9/h9H,3-7H2,1-2H3
InChIKeyZHVJPDIDNQFDJP-UHFFFAOYSA-N
MW155.24 g/mol
LogP2.73
Rot. Bonds2

About N-cyclohexyloxypropan-2-imine

N-cyclohexyloxypropan-2-imine (PubChem CID 130635287) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-cyclohexyloxypropan-2-imine.

Molecular Properties

Compound NameN-cyclohexyloxypropan-2-imine
PubChem CID130635287
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-cyclohexyloxypropan-2-imine
SMILESCC(C)=NOC1CCCCC1
InChIInChI=1S/C9H17NO/c1-8(2)10-11-9-6-4-3-5-7-9/h9H,3-7H2,1-2H3
InChIKeyZHVJPDIDNQFDJP-UHFFFAOYSA-N
XLogP2.73
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyloxypropan-2-imine
CID 175552910
2-cyclopentyloxyguanidine
CID 55290146
N-[4-[4-(4-methanidylcyclohexyl)cyclohexyl]cyclohexyl]oxypropan-2-imine;yttrium(3+)
CID 21015059
cyclohexyl nitrite;nitrous acid
CID 174432355
cycloheptadecyl acetate
CID 57215828
4-bromo-2-cyclohexyloxyimino-3-oxohexanoic acid
CID 173396172
(E)-1-[5-chloro-2-(trifluoromethyl)phenyl]-N-cyclohexyloxyethanimine
CID 88957441
azane;cyclohexyl acetate
CID 174554221
cyclohexyl acetate;dihydrochloride
CID 140971070
methoxycyclooctane
CID 551195
cyclohexane;hydroperoxycyclohexane
CID 88671084
cyclohexyloxy(dimethyl)sulfanium
CID 10519009

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyloxypropan-2-imine?
The IUPAC name of N-cyclohexyloxypropan-2-imine (CID 130635287) is N-cyclohexyloxypropan-2-imine.
What is the SMILES notation for N-cyclohexyloxypropan-2-imine?
The canonical SMILES for N-cyclohexyloxypropan-2-imine is CC(C)=NOC1CCCCC1.
What is the InChIKey of N-cyclohexyloxypropan-2-imine?
The InChIKey is ZHVJPDIDNQFDJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(2)10-11-9-6-4-3-5-7-9/h9H,3-7H2,1-2H3.
What are the key properties of N-cyclohexyloxypropan-2-imine?
N-cyclohexyloxypropan-2-imine has a molecular weight of 155.24 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyloxypropan-2-imine is sourced from PubChem (CID 130635287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).